10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione

C22H17NO3 — CID 2937056

IUPAC10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione
SMILESO=C1CCCC2=C1C(c1cccc(O)c1)C1=C(N2)c2ccccc2C1=O
InChIInChI=1S/C22H17NO3/c24-13-6-3-5-12(11-13)18-19-16(9-4-10-17(19)25)23-21-14-7-1-2-8-15(14)22(26)20(18)21/h1-3,5-8,11,18,23-24H,4,9-10H2
InChIKeyMJNXUGYYMOXRQF-UHFFFAOYSA-N
MW343.38 g/mol
LogP3.69
Rot. Bonds1

About 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione

10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione (PubChem CID 2937056) has the molecular formula C22H17NO3 and a molecular weight of 343.38 g/mol. Its IUPAC name is 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione.

Molecular Properties

Compound Name10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione
PubChem CID2937056
Molecular FormulaC22H17NO3
Molecular Weight343.38 g/mol
Exact Mass343.12
IUPAC Name10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione
SMILESO=C1CCCC2=C1C(c1cccc(O)c1)C1=C(N2)c2ccccc2C1=O
InChIInChI=1S/C22H17NO3/c24-13-6-3-5-12(11-13)18-19-16(9-4-10-17(19)25)23-21-14-7-1-2-8-15(14)22(26)20(18)21/h1-3,5-8,11,18,23-24H,4,9-10H2
InChIKeyMJNXUGYYMOXRQF-UHFFFAOYSA-N
XLogP3.69
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.38
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione?
The IUPAC name of 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione (CID 2937056) is 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione.
What is the SMILES notation for 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione?
The canonical SMILES for 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione is O=C1CCCC2=C1C(c1cccc(O)c1)C1=C(N2)c2ccccc2C1=O.
What is the InChIKey of 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione?
The InChIKey is MJNXUGYYMOXRQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17NO3/c24-13-6-3-5-12(11-13)18-19-16(9-4-10-17(19)25)23-21-14-7-1-2-8-15(14)22(26)20(18)21/h1-3,5-8,11,18,23-24H,4,9-10H2.
What are the key properties of 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione?
10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione has a molecular weight of 343.38 g/mol, XLogP of 3.69, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3-hydroxyphenyl)-6,7,8,10-tetrahydro-5H-indeno[1,2-b]quinoline-9,11-dione is sourced from PubChem (CID 2937056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).